ethyl 5-[3-[(4-chlorophenyl)amino]-2-oxidanyl-propoxy]-2-methyl-1-(4-methylphenyl)indole-3-carboxylate

Systemtic Name: ethyl 5-[3-[(4-chlorophenyl)amino]-2-oxidanyl-propoxy]-2-methyl-1-(4-methylphenyl)indole-3-carboxylate Openeye Name: ethyl 5-[3-(4-chloroanilino)-2-hydroxy-propoxy]-2-methyl-1-(p-tolyl)indole-3-carboxylate CAS Name: 5-[3-(4-chloroanilino)-2-hydroxypropoxy]-2-methyl-1-(4-methylphenyl)-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[3-(4-chloroanilino)-2-hydroxypropoxy]-2-methyl-1-(4-methylphenyl)indole-3-carboxylate Traditional Name: 5-[3-(4-chloroanilino)-2-hydroxy-propoxy]-2-methyl-1-(p-tolyl)indole-3-carboxylic acid ethyl ester Formula: C28H29ClN2O4 MolecularWeight: 492.99386

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(CNC3=CC=C(C=C3)Cl)O)C4=CC=C(C=C4)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(CNC3=CC=C(C=C3)Cl)O)C4=CC=C(C=C4)C)C

InChI

InChI=1S/C28H29ClN2O4/c1-4-34-28(33)27-19(3)31(22-11-5-18(2)6-12-22)26-14-13-24(15-25(26)27)35-17-23(32)16-30-21-9-7-20(29)8-10-21/h5-15,23,30,32H,4,16-17H2,1-3H3